3-Bromomethyl-3-oxetanemethanol

• CAS: 22633-44-9
• Catalog Number: ACM22633449
• Category: Bromine Series

Custom Q&A

What is the molecular formula of 3-Bromomethyl-3-oxetanemethanol?

The molecular formula of 3-Bromomethyl-3-oxetanemethanol is C5H9BrO2.

What is the IUPAC name of 3-Bromomethyl-3-oxetanemethanol?

The IUPAC name of 3-Bromomethyl-3-oxetanemethanol is [3-(bromomethyl)oxetan-3-yl]methanol.

What is the InChI of 3-Bromomethyl-3-oxetanemethanol?

The InChI of 3-Bromomethyl-3-oxetanemethanol is InChI=1S/C5H9BrO2/c6-1-5(2-7)3-8-4-5/h7H,1-4H2.

What is the InChIKey of 3-Bromomethyl-3-oxetanemethanol?

The InChIKey of 3-Bromomethyl-3-oxetanemethanol is SESXZSLSTRITGO-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Bromomethyl-3-oxetanemethanol?

The canonical SMILES of 3-Bromomethyl-3-oxetanemethanol is C1C(CO1)(CO)CBr.

What is the molecular weight of 3-Bromomethyl-3-oxetanemethanol?

The molecular weight of 3-Bromomethyl-3-oxetanemethanol is 181.03 g/mol.

How many hydrogen bond donor counts are there in 3-Bromomethyl-3-oxetanemethanol?

There is 1 hydrogen bond donor count in 3-Bromomethyl-3-oxetanemethanol.

How many hydrogen bond acceptor counts are there in 3-Bromomethyl-3-oxetanemethanol?

There are 2 hydrogen bond acceptor counts in 3-Bromomethyl-3-oxetanemethanol.

What is the topological polar surface area of 3-Bromomethyl-3-oxetanemethanol?

The topological polar surface area of 3-Bromomethyl-3-oxetanemethanol is 29.5Ų.

Is 3-Bromomethyl-3-oxetanemethanol a canonicalized compound?

Yes, 3-Bromomethyl-3-oxetanemethanol is a canonicalized compound.

Synthetic Use

Upstream Synthesis Route 1

• 1522-92-5

• 174-79-8
• 2402-83-7
• 22633-44-9

Reference: [1] Environmental Science and Technology, 2005, vol. 39, # 2, p. 505 - 512

Upstream Synthesis Route 2

• 3296-90-0

• 22633-44-9

Reference: [1] Tetrahedron Letters, 2011, vol. 52, # 5, p. 565 - 567

Upstream Synthesis Route 3

• 3296-90-0

• 22633-44-9

Reference: [1]Tetrahedron Letters,2011,vol. 52,p. 565 - 567

Downstream Synthesis Route 1

• 22633-44-9
• 143-33-9

• 42941-62-8

Reference: [1]Mededelingen van de Koninklijke Vlaamse Academie voor Wetenschappen, Letteren en Schone Kunsten van Belgie, Klasse der Wetenschappen,1954,vol. 16,p. 3,10
[2]Patent: WO2008/99020,2008,A1 .Location in patent: Page/Page column 157-158

Downstream Synthesis Route 2

• 22633-44-9

• 3296-89-7

Reference: [1]Mededelingen van de Koninklijke Vlaamse Academie voor Wetenschappen, Letteren en Schone Kunsten van Belgie, Klasse der Wetenschappen,1954,vol. 16,p. 3,10

* For details of the synthesis route, please refer to the original source to ensure accuracy.